#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2eol s SER 2 N 0.00 5.59 -0.02 1.61 0.01 -1.26 -5.08 113.70 114.55 2eol s SER 2 Ca 0.00 0.09 -0.28 0.00 1.31 0.00 0.00 55.95 57.07 2eol s SER 2 Cb 0.00 -1.93 0.09 0.00 0.21 0.00 0.00 66.02 64.40 2eol s SER 2 CO 0.00 0.20 0.80 -0.55 0.41 0.00 0.00 173.24 174.10 2eol s SER 3 N 0.22 -0.48 -0.53 2.44 0.15 -1.26 -5.12 113.70 109.12 2eol s SER 3 Ca 0.04 0.26 0.04 0.00 0.70 0.00 0.00 55.95 56.99 2eol s SER 3 Cb -0.12 0.45 0.16 0.00 -1.71 0.00 0.00 66.02 64.79 2eol s SER 3 CO 0.01 -0.63 0.35 -0.83 1.20 0.00 0.00 173.24 173.34 2eol s GLY 4 N -1.92 2.04 -0.05 9.45 0.00 -1.26 -5.09 107.32 110.49 2eol s GLY 4 Ca -0.01 -3.03 0.06 0.00 0.00 0.00 0.00 44.72 41.74 2eol s GLY 4 CO -0.03 1.50 -0.24 -0.45 0.00 0.00 0.00 173.10 173.89 2eol s SER 5 N -0.39 2.89 -0.40 1.64 0.15 -1.26 -5.07 113.70 111.27 2eol s SER 5 Ca 0.24 -0.48 -0.27 0.00 0.70 0.00 0.00 55.95 56.14 2eol s SER 5 Cb -0.10 -0.77 -0.05 0.00 -1.71 0.00 0.00 66.02 63.38 2eol s SER 5 CO -0.11 0.23 2.26 -0.55 1.20 0.00 0.00 173.24 176.27 2eol s SER 6 N -0.15 4.94 -0.32 5.45 0.15 -1.26 -4.81 113.70 117.71 2eol s SER 6 Ca -0.03 1.30 0.14 0.00 0.70 0.00 0.00 55.95 58.06 2eol s SER 6 Cb -0.13 -2.51 0.47 0.00 -1.71 0.00 0.00 66.02 62.14 2eol s SER 6 CO 0.03 -2.46 1.10 0.61 1.20 0.00 0.00 173.24 173.72 2eol n GLY 7 N 5.86 3.86 3.63 9.45 0.00 -1.26 -5.06 105.19 121.67 2eol n GLY 7 Ca 0.32 -1.90 -0.43 0.00 0.00 0.00 0.00 46.02 44.01 2eol n GLY 7 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2eol s GLU 8 N -3.55 4.00 -0.54 1.61 8.01 -1.26 -5.00 118.70 121.97 2eol s GLU 8 Ca 0.38 0.94 -0.16 0.00 0.01 0.00 0.00 54.97 56.14 2eol s GLU 8 Cb 0.39 -3.76 0.12 0.00 -4.31 0.00 0.00 34.13 26.57 2eol s GLU 8 CO -0.03 -0.96 0.50 0.15 0.01 0.00 0.00 175.26 174.94 2eol s LYS 9 N 3.71 2.99 0.00 1.61 1.02 -1.26 -4.78 119.74 123.03 2eol s LYS 9 Ca 0.45 -1.64 0.14 0.00 0.02 0.00 0.00 55.97 54.94 2eol s LYS 9 Cb -0.12 -4.28 0.63 0.00 -0.52 0.00 0.00 37.83 33.55 2eol s LYS 9 CO 0.18 -1.31 1.45 -0.35 -0.92 0.00 0.00 175.35 174.39 2eol n PRO 10 N 5.33 0.04 -4.73 -1.68 -0.04 -1.26 -4.64 135.00 128.02 2eol n PRO 10 Ca -0.13 0.23 -0.33 0.00 -0.04 0.00 0.00 63.50 63.23 2eol n PRO 10 Cb 0.41 -1.50 -0.13 0.00 -0.04 0.00 0.00 33.50 32.23 2eol n PRO 10 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 2eol s TYR 11 N -2.92 2.83 0.03 0.54 2.02 -1.21 -5.05 117.35 113.59 2eol s TYR 11 Ca 0.08 -0.42 0.01 0.00 -0.37 0.00 0.00 57.07 56.37 2eol s TYR 11 Cb 0.09 -1.80 -0.02 0.00 -0.40 0.00 0.00 41.96 39.83 2eol s TYR 11 CO 0.25 -0.05 -0.05 -1.21 -1.57 0.00 0.00 175.55 172.93 2eol s GLU 12 N 0.01 0.39 -0.15 -0.62 8.01 -1.26 -0.67 118.70 124.41 2eol s GLU 12 Ca -0.03 -0.62 -0.28 0.00 0.01 0.00 0.00 54.97 54.05 2eol s GLU 12 Cb -0.14 -0.09 -0.01 0.00 -4.31 0.00 0.00 34.13 29.58 2eol s GLU 12 CO 0.04 0.00 0.96 0.00 0.01 0.00 0.00 175.26 176.27 2eol n THR 14 N 4.77 1.88 0.00 0.00 -2.24 -1.26 -1.87 114.28 115.56 2eol n THR 14 Ca 0.08 -0.76 0.00 0.00 -2.27 0.00 0.00 64.05 61.10 2eol n THR 14 Cb 0.48 -0.83 0.00 0.00 -2.10 0.00 0.00 70.33 67.88 2eol n THR 14 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2eol n ASP 15 N -0.09 3.01 0.00 3.42 9.92 -1.26 -4.93 116.55 126.62 2eol n ASP 15 Ca 0.23 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.49 2eol n ASP 15 Cb 0.93 0.04 0.00 0.00 -0.64 0.00 0.00 41.12 41.45 2eol n ASP 15 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2eol n GLY 17 N 2.88 1.76 3.74 0.00 0.00 -0.78 -5.06 105.19 107.72 2eol n GLY 17 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 2eol n GLY 17 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2eol s LYS 18 N -0.02 0.49 0.07 1.61 2.20 -1.25 -4.71 119.74 118.12 2eol s LYS 18 Ca 0.00 0.19 0.03 0.00 -0.36 0.00 0.00 55.97 55.82 2eol s LYS 18 Cb 0.00 -1.77 -0.03 0.00 -1.51 0.00 0.00 37.83 34.52 2eol s LYS 18 CO 0.00 -2.62 -0.08 0.00 -0.36 0.00 0.00 175.35 172.29 2eol s ALA 19 N -3.23 0.83 -0.18 3.13 0.00 -1.26 -0.55 121.76 120.50 2eol s ALA 19 Ca 0.67 -1.02 -0.07 0.00 0.00 0.00 0.00 51.96 51.53 2eol s ALA 19 Cb -0.13 0.06 0.08 0.00 0.00 0.00 0.00 23.12 23.13 2eol s ALA 19 CO 0.55 -0.07 0.39 -0.06 0.00 0.00 0.00 175.76 176.57 2eol s PHE 20 N -2.19 -0.72 0.10 0.00 0.40 0.15 -4.97 117.98 110.76 2eol s PHE 20 Ca -0.00 1.41 0.30 0.00 -0.60 0.00 0.00 56.93 58.04 2eol s PHE 20 Cb -0.04 0.25 1.61 0.00 0.51 0.00 0.00 43.02 45.35 2eol s PHE 20 CO -0.01 -0.44 1.92 0.78 0.70 0.00 0.00 175.22 178.17 2eol h GLY 21 N 8.03 0.00 -2.37 4.36 0.00 -1.86 -3.21 103.07 108.02 2eol h GLY 21 Ca -0.19 0.00 -0.59 0.00 0.00 0.00 0.00 47.33 46.56 2eol h GLY 21 CO 0.15 0.00 -0.70 1.08 0.00 0.00 0.00 176.54 177.07 2eol s LEU 22 N -5.12 2.88 0.07 3.11 1.43 -1.26 -4.73 118.68 115.06 2eol s LEU 22 Ca -0.03 -0.85 0.05 0.00 -1.03 0.00 0.00 54.13 52.27 2eol s LEU 22 Cb 0.09 -1.39 -0.23 0.00 0.03 0.00 0.00 46.19 44.68 2eol s LEU 22 CO 0.29 0.01 1.09 0.50 0.23 0.00 0.00 176.35 178.47 2eol h LYS 23 N 2.08 0.07 0.02 1.70 1.63 -1.99 -3.28 116.57 116.80 2eol h LYS 23 Ca -0.42 -0.12 -0.21 0.00 -0.85 0.00 0.00 60.65 59.05 2eol h LYS 23 Cb 1.25 0.04 -0.01 0.00 -0.60 0.00 0.00 32.23 32.91 2eol h LYS 23 CO 0.60 0.95 -0.96 1.03 -3.45 0.00 0.00 179.45 177.62 2eol h SER 24 N 0.02 0.20 0.24 4.20 0.87 -1.96 -2.94 113.55 114.18 2eol h SER 24 Ca -0.11 -0.18 -0.05 0.00 -1.23 0.00 0.00 61.79 60.21 2eol h SER 24 Cb 1.88 -0.06 -0.01 0.00 -0.44 0.00 0.00 62.40 63.76 2eol h SER 24 CO 0.13 1.05 -0.24 1.56 -0.53 0.00 0.00 176.83 178.80 2eol h GLN 25 N 0.07 0.01 0.04 2.24 4.20 -1.95 -2.60 115.11 117.11 2eol h GLN 25 Ca -0.05 -0.00 -0.06 0.00 0.06 0.00 0.00 58.65 58.60 2eol h GLN 25 Cb 1.63 -0.00 0.01 0.00 0.30 0.00 0.00 27.48 29.42 2eol h GLN 25 CO 0.14 0.25 -0.26 1.25 -0.67 0.00 0.00 178.83 179.54 2eol h LEU 26 N 0.01 0.17 -0.60 1.46 5.85 -1.61 -3.18 115.31 117.41 2eol h LEU 26 Ca -0.00 -0.93 0.12 0.00 0.84 0.00 0.00 57.88 57.91 2eol h LEU 26 Cb 0.43 -0.05 -0.09 0.00 0.37 0.00 0.00 40.66 41.32 2eol h LEU 26 CO 0.03 1.08 0.09 0.40 -0.34 0.00 0.00 178.44 179.70 2eol h ILE 27 N -0.72 0.59 -0.51 4.05 2.04 -1.41 0.12 117.51 121.67 2eol h ILE 27 Ca -0.04 -0.07 0.00 0.00 1.00 0.00 0.00 64.86 65.75 2eol h ILE 27 Cb 1.16 0.37 -0.03 0.00 -0.74 0.00 0.00 36.82 37.58 2eol h ILE 27 CO 0.05 0.04 0.32 0.40 0.00 0.00 0.00 178.15 178.96 2eol h ILE 28 N 0.21 1.14 0.16 -0.67 2.04 -1.58 -2.90 117.51 115.90 2eol h ILE 28 Ca 0.32 -0.28 -0.01 0.00 1.00 0.00 0.00 64.86 65.89 2eol h ILE 28 Cb 0.49 0.41 0.00 0.00 -0.74 0.00 0.00 36.82 36.98 2eol h ILE 28 CO -0.44 0.14 -0.07 -0.74 0.00 0.00 0.00 178.15 177.03 2eol h HIS 29 N 0.69 -0.19 -0.24 1.37 2.76 -0.84 -2.97 115.15 115.73 2eol h HIS 29 Ca 0.18 -0.00 0.07 0.00 -2.20 0.00 0.00 60.37 58.42 2eol h HIS 29 Cb -0.05 0.06 -0.01 0.00 1.55 0.00 0.00 27.41 28.96 2eol h HIS 29 CO 0.00 0.21 0.82 1.96 -1.30 0.00 0.00 177.93 179.62 2eol h GLN 30 N -0.67 0.00 0.42 5.26 4.20 -0.83 0.12 115.11 123.61 2eol h GLN 30 Ca -0.02 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.67 2eol h GLN 30 Cb 0.49 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.28 2eol h GLN 30 CO 0.04 0.00 -0.20 0.00 -0.67 0.00 0.00 178.83 177.99 2eol h ARG 31 N 0.00 -0.55 -0.15 1.46 3.08 -1.48 -1.46 114.38 115.28 2eol h ARG 31 Ca 0.11 0.04 0.04 0.00 0.07 0.00 0.00 59.98 60.24 2eol h ARG 31 Cb 1.75 0.12 -0.01 0.00 0.08 0.00 0.00 29.97 31.92 2eol h ARG 31 CO -0.00 -0.37 0.51 0.00 -1.07 0.00 0.00 179.97 179.05 2eol h THR 32 N -0.57 0.08 0.00 2.04 1.03 -0.93 -1.25 112.91 113.32 2eol h THR 32 Ca -0.06 0.00 -0.07 0.00 -0.01 0.00 0.00 66.41 66.27 2eol h THR 32 Cb 0.44 0.52 -0.01 0.00 -1.07 0.00 0.00 68.15 68.02 2eol h THR 32 CO 0.09 0.00 -0.52 0.45 -0.01 0.00 0.00 175.52 175.54 2eol h HIS 33 N 0.00 0.00 -1.76 0.00 3.86 -1.42 -3.44 115.15 112.39 2eol h HIS 33 Ca 0.07 0.00 -0.49 0.00 -1.16 0.00 0.00 60.37 58.79 2eol h HIS 33 Cb 1.10 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.57 2eol h HIS 33 CO 0.00 0.69 1.57 0.95 0.86 0.00 0.00 177.93 182.00 2eol s THR 34 N -2.13 3.06 0.00 2.45 -4.23 -0.47 -3.32 115.64 111.00 2eol s THR 34 Ca -0.17 0.05 0.00 0.00 -1.18 0.00 0.00 61.69 60.39 2eol s THR 34 Cb 0.02 -3.15 0.00 0.00 1.34 0.00 0.00 72.50 70.71 2eol s THR 34 CO 0.40 -0.14 0.00 0.61 -0.54 0.00 0.00 174.62 174.95 2eol n GLY 35 N 5.91 0.62 3.28 3.99 0.00 -1.26 -4.91 105.19 112.81 2eol n GLY 35 Ca 0.33 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.21 2eol n GLY 35 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2eol s GLU 36 N 0.00 0.72 0.29 1.61 2.56 -1.21 -5.04 118.70 117.63 2eol s GLU 36 Ca 0.00 -0.12 -0.01 0.00 0.00 0.00 0.00 54.97 54.83 2eol s GLU 36 Cb 0.00 0.32 0.65 0.00 2.00 0.00 0.00 34.13 37.11 2eol s GLU 36 CO 0.00 -0.20 1.58 0.66 -0.56 0.00 0.00 175.26 176.74 2eol h SER 37 N 3.75 -0.50 -4.80 -1.70 4.64 -2.01 -3.47 113.55 109.45 2eol h SER 37 Ca -0.29 0.26 0.00 0.00 -0.47 0.00 0.00 61.79 61.29 2eol h SER 37 Cb 1.17 0.47 -0.01 0.00 -0.31 0.00 0.00 62.40 63.73 2eol h SER 37 CO 0.40 -0.31 -0.88 0.61 -0.87 0.00 0.00 176.83 175.77 2eol n GLY 38 N -1.50 -4.17 0.00 -0.77 0.00 -1.26 -4.83 105.19 92.66 2eol n GLY 38 Ca 0.20 0.44 0.08 0.00 0.00 0.00 0.00 46.02 46.74 2eol n GLY 38 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2eol n PRO 39 N 0.66 0.46 -3.84 1.61 -0.04 -1.26 -4.58 135.00 128.01 2eol n PRO 39 Ca -0.03 0.02 -0.36 0.00 -0.04 0.00 0.00 63.50 63.09 2eol n PRO 39 Cb 0.04 -1.50 -0.13 0.00 -0.04 0.00 0.00 33.50 31.87 2eol n PRO 39 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2eol s SER 40 N -2.06 4.67 0.01 3.54 1.04 -1.26 -5.05 113.70 114.58 2eol s SER 40 Ca 0.22 -0.36 -0.38 0.00 0.48 0.00 0.00 55.95 55.92 2eol s SER 40 Cb 0.11 -1.82 -0.19 0.00 0.10 0.00 0.00 66.02 64.22 2eol s SER 40 CO 0.19 -0.04 1.00 -1.20 0.98 0.00 0.00 173.24 174.17 2eol n SER 41 N 4.85 -0.06 0.00 7.02 7.64 -1.26 -5.19 113.62 126.61 2eol n SER 41 Ca -0.17 1.11 0.00 0.00 1.01 0.00 0.00 58.87 60.82 2eol n SER 41 Cb 0.51 -0.88 0.00 0.00 -1.01 0.00 0.00 64.21 62.82 2eol n SER 41 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64